SCHEMBL3070118

SCHEMBL3070118

COC(=O)c1ccccc1N(c1ccccc1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.57
TSHR P16473 3/20 0.52
LMNA P02545 1/20 0.52
ALDH1A1 P00352 1/20 0.50
CFTR P13569 1/20 0.50
HSD17B10 Q99714 1/20 0.50
MAPT P10636 1/20 0.49
ALOX15 P16050 1/20 0.49
KDM4E B2RXH2 1/20 0.49
POLB P06746 1/20 0.49
ATM Q13315 1/20 0.49
SLC6A3 Q01959 1/20 0.47
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA5A P35218 1/20 0.45
CA9 Q16790 1/20 0.45
GAA P10253 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MYC P01106 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13353027 0.96 KMT2A (0.57) KMT2ATSHRLMNAALDH1A1CFTR
SCHEMBL14691040 0.92 KMT2A (0.50) KMT2ATSHRLMNAALDH1A1CFTR
SCHEMBL18810823 0.90 KMT2A (0.51) KMT2ATSHRLMNAALDH1A1CFTR
SCHEMBL18624215 0.89 KMT2A (0.50) KMT2ATSHRLMNAALDH1A1CFTR
SCHEMBL30492227 0.89 KMT2A (0.64) KMT2ATSHRLMNAALDH1A1CFTR
SCHEMBL13066502 0.89 KMT2A (0.64) KMT2ATSHRLMNAALDH1A1CFTR
SCHEMBL6935168 0.86 TSHR (0.47) KMT2ATSHRLMNAALDH1A1CFTR
SCHEMBL14691245 0.85 KMT2A (0.47) KMT2ATSHRLMNAALDH1A1CFTR
SCHEMBL4956421 0.84 KMT2A (0.59) KMT2ATSHRLMNAALDH1A1CFTR
SCHEMBL18280693 0.84 TDP1 (0.50) KMT2ATSHRLMNAALDH1A1CFTR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017216299-A1 EMITTER MOLECULES ON THE BASIS OF DUAL-FLUORESCENCE BENZENE (POLY)CARBOXYLATE ACCEPTORS Technische Universität Dresden (DE) 2017-12-21 WO disclosed
US-20170125701-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-05-04 US disclosed
US-20170125701-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-05-04 US disclosed
US-9102616-B2 Organic compound, organic electronic device using same, and terminal for same DUK SAN NEOLUX CO., LTD. (KR) 2015-08-11 US disclosed
US-9102616-B2 Organic compound, organic electronic device using same, and terminal for same DUK SAN NEOLUX CO., LTD. (KR) 2015-08-11 US disclosed
US-20130065318-A1 DETECTION OF ANALYTES INCLUDING NITRO-CONTAINING ANALYTES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-03-14 US disclosed
US-8384068-B2 Use of acridine derivatives as matrix materials and/or electron blockers in OLEDs BASF SE (DE) 2013-02-26 US disclosed
EP-2195868-B1 USE OF ACRIDINE DERIVATIVES AS MATRIX MATERIALS AND/OR AN ELECTRON BLOCKER IN OLEDS BASF SE (DE) 2013-01-02 EP disclosed
US-20120217492-A1 ORGANIC COMPOUND, ORGANIC ELECTRONIC DEVICE USING SAME, AND TERMINAL FOR SAME DUKSAN HIGH METAL CO., LTD. (KR) 2012-08-30 US disclosed
US-20120217492-A1 ORGANIC COMPOUND, ORGANIC ELECTRONIC DEVICE USING SAME, AND TERMINAL FOR SAME DUKSAN HIGH METAL CO., LTD. (KR) 2012-08-30 US disclosed
US-20100219406-A1 USE OF ACRIDINE DERIVATIVES AS MATRIX MATERIALS AND/OR ELECTRON BLOCKERS IN OLEDS BASF SE (DE) 2010-09-02 US disclosed
EP-2195868-A1 USE OF ACRIDINE DERIVATIVES AS MATRIX MATERIALS AND/OR AN ELECTRON BLOCKER IN OLEDS Basf Se (DE) 2010-06-16 EP disclosed
WO-2009047147-A1 USE OF ACRIDINE DERIVATIVES AS MATRIX MATERIALS AND/OR AN ELECTRON BLOCKER IN OLEDS BASF SE (DE) 2009-04-16 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120217492-A1 ORGANIC COMPOUND, ORGANIC ELECTRONIC DEVICE USING SAME, AND TERMINAL FOR SAME OR10J3, OR51E2, ORC3 KMT2A 859/4885TSHR 3493/4885LMNA 4394/4885
US-20170125701-A1 MATERIALS FOR ELECTRONIC DEVICES HCN2, EFNA1, EED KMT2A 1344/4885TSHR 3625/4885LMNA 3507/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.